Crystal structure and Hirshfeld surface analysis of 4′-chloro-5-oxo-N-phenyl-3-(thio­phen-2-yl)-2,3,4,5-tetra­hydro-[1,1′-biphen­yl]-4-carboxamide monohydrate

Naghiyev F. N., Khrustalev V. N., Nevskaya E. Y., AKKURT M., Ashurov J. M., Hamouda H. A., ...Daha Fazla

Acta Crystallographica Section E: Crystallographic Communications, cilt.82, ss.1019-1024, 2026 (ESCI, Scopus)

  • Yayın Türü: Makale / Tam Makale
  • Cilt numarası: 82
  • Basım Tarihi: 2026
  • Doi Numarası: 10.1107/s2056989026007826
  • Dergi Adı: Acta Crystallographica Section E: Crystallographic Communications
  • Derginin Tarandığı İndeksler: Emerging Sources Citation Index (ESCI), Scopus
  • Sayfa Sayıları: ss.1019-1024
  • Anahtar Kelimeler: crystal structure, disorder, face-to-face π–π inter­actions, Hirshfeld surface analysis, thio­phene ring
  • Erciyes Üniversitesi Adresli: Evet

Özet

The title mol­ecule, C23H18ClNO2S·H2O, has a stable conformation with S(5) and S(6) rings formed by intra­molecular C—H⋯S and C—H⋯O hydrogen bonds. The water mol­ecule and the carboxyl oxygen atom of the main mol­ecule also make an O—H⋯O hydrogen bond. In the crystal, N—H⋯O, O—H⋯Cl, O—H⋯O and C—H⋯O hydrogen bonds connect mol­ecules to form a three-dimensional network. The mol­ecules are further connected by C—H⋯π inter­actions and face-to-face π–π inter­actions into layers parallel to the (001) plane.